#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lr1 h GLU 2 N 0.00 0.00 0.00 4.33 4.81 -2.04 -2.16 114.58 119.52 1lr1 h GLU 2 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1lr1 h GLU 2 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1lr1 h GLU 2 CO 0.00 0.04 -0.12 0.00 -0.73 0.00 0.00 179.01 178.20 1lr1 h ALA 3 N 1.96 0.97 0.09 2.92 0.00 -1.98 0.53 119.26 123.75 1lr1 h ALA 3 Ca -0.00 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.59 1lr1 h ALA 3 Cb 0.55 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1lr1 h ALA 3 CO 0.00 0.15 -1.06 -0.07 0.00 0.00 0.00 179.25 178.28 1lr1 h LEU 4 N 0.00 0.29 0.00 0.00 4.07 -1.84 -3.36 115.31 114.47 1lr1 h LEU 4 Ca -0.00 -0.85 -0.07 0.00 0.08 0.00 0.00 57.88 57.04 1lr1 h LEU 4 Cb 0.80 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 1lr1 h LEU 4 CO 0.02 1.46 -0.38 0.50 -1.08 0.00 0.00 178.44 178.96 1lr1 h LYS 5 N -0.51 0.00 -0.36 1.13 1.63 -1.44 0.21 116.57 117.22 1lr1 h LYS 5 Ca -0.23 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 59.63 1lr1 h LYS 5 Cb 1.56 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 33.14 1lr1 h LYS 5 CO 0.03 0.30 0.04 0.97 -3.45 0.00 0.00 179.45 177.35 1lr1 h ILE 6 N 0.00 0.78 0.00 2.00 -0.00 -0.09 -2.55 117.51 117.66 1lr1 h ILE 6 Ca -0.01 -0.05 0.00 0.00 -0.00 0.00 0.00 64.86 64.80 1lr1 h ILE 6 Cb 1.25 0.62 0.00 0.00 -0.00 0.00 0.00 36.82 38.69 1lr1 h ILE 6 CO 0.04 0.03 -0.93 0.00 -0.00 0.00 0.00 178.15 177.29 1lr1 n LEU 7 N -5.14 0.75 -1.30 2.19 -0.00 -1.25 -4.87 117.00 107.38 1lr1 n LEU 7 Ca 0.02 -0.45 -0.13 0.00 -0.00 0.00 0.00 56.01 55.44 1lr1 n LEU 7 Cb 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.56 1lr1 n LEU 7 CO 0.23 0.19 -0.15 0.59 -0.00 0.00 0.00 177.39 178.24 1lr1 n ASN 8 N -1.49 -4.39 -1.43 1.45 3.02 0.55 -4.63 115.26 108.35 1lr1 n ASN 8 Ca 0.03 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1lr1 n ASN 8 Cb 0.29 -3.34 0.00 0.00 -0.61 0.00 0.00 39.78 36.13 1lr1 n ASN 8 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1lr1 n ASN 9 N -0.39 -7.75 0.32 6.41 5.03 -0.18 -4.22 115.26 114.49 1lr1 n ASN 9 Ca -0.15 1.06 0.19 0.00 0.87 0.00 0.00 54.58 56.55 1lr1 n ASN 9 Cb 0.54 -3.79 1.01 0.00 -1.02 0.00 0.00 39.78 36.52 1lr1 n ASN 9 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.26 175.59 1lr1 h ILE 10 N 2.12 0.00 0.63 2.41 -2.65 -1.92 -1.22 117.51 116.88 1lr1 h ILE 10 Ca 0.00 0.00 -0.03 0.00 1.03 0.00 0.00 64.86 65.86 1lr1 h ILE 10 Cb 0.00 0.82 0.00 0.00 -2.05 0.00 0.00 36.82 35.59 1lr1 h ILE 10 CO 0.00 0.00 -0.34 0.08 0.03 0.00 0.00 178.15 177.92 1lr1 h ARG 11 N 0.00 -0.87 0.00 0.16 0.11 -1.95 0.15 114.38 111.98 1lr1 h ARG 11 Ca 0.00 0.06 -0.25 0.00 0.10 0.00 0.00 59.98 59.89 1lr1 h ARG 11 Cb 0.26 0.20 -0.04 0.00 1.11 0.00 0.00 29.97 31.50 1lr1 h ARG 11 CO 0.00 -0.58 -1.36 0.00 0.10 0.00 0.00 179.97 178.14 1lr1 h THR 12 N -0.90 1.23 -0.30 0.08 1.03 -1.69 -3.34 112.91 109.02 1lr1 h THR 12 Ca -0.08 -3.00 -0.00 0.00 -0.01 0.00 0.00 66.41 63.31 1lr1 h THR 12 Cb 0.71 2.60 -0.01 0.00 -1.07 0.00 0.00 68.15 70.38 1lr1 h THR 12 CO 0.11 0.70 0.18 0.25 -0.01 0.00 0.00 175.52 176.76 1lr1 h LEU 13 N 0.00 0.36 -1.40 0.00 7.12 -1.23 0.16 115.31 120.32 1lr1 h LEU 13 Ca -0.15 -0.04 0.21 0.00 0.13 0.00 0.00 57.88 58.03 1lr1 h LEU 13 Cb 1.88 -0.09 -0.08 0.00 -0.53 0.00 0.00 40.66 41.84 1lr1 h LEU 13 CO 0.10 0.29 0.62 -0.09 -0.13 0.00 0.00 178.44 179.23 1lr1 h ARG 14 N 0.39 0.46 0.05 1.25 9.65 -0.81 0.35 114.38 125.71 1lr1 h ARG 14 Ca 0.11 -0.03 -0.21 0.00 -1.10 0.00 0.00 59.98 58.75 1lr1 h ARG 14 Cb 0.00 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.46 1lr1 h ARG 14 CO -0.02 0.30 -1.12 0.00 2.80 0.00 0.00 179.97 181.94 1lr1 h ALA 15 N 1.61 0.18 -0.36 2.80 0.00 -1.56 -1.41 119.26 120.53 1lr1 h ALA 15 Ca 0.51 -1.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1lr1 h ALA 15 Cb 1.18 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 1lr1 h ALA 15 CO -0.23 0.64 0.08 -0.56 0.00 0.00 0.00 179.25 179.19 1lr1 h GLN 16 N -0.67 0.52 0.00 0.00 3.07 -0.35 -1.47 115.11 116.21 1lr1 h GLN 16 Ca -0.27 -0.08 -0.09 0.00 0.09 0.00 0.00 58.65 58.30 1lr1 h GLN 16 Cb 1.46 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 28.92 1lr1 h GLN 16 CO -0.05 0.48 -0.88 0.00 0.09 0.00 0.00 178.83 178.47 1lr1 h ALA 17 N 1.59 0.67 -1.16 0.06 0.00 -0.46 -3.31 119.26 116.64 1lr1 h ALA 17 Ca 0.12 -0.42 0.33 0.00 0.00 0.00 0.00 54.91 54.93 1lr1 h ALA 17 Cb 0.20 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1lr1 h ALA 17 CO -0.00 0.50 0.80 -0.09 0.00 0.00 0.00 179.25 180.46 1lr1 h ARG 18 N 0.00 0.12 -0.98 0.00 9.65 -0.13 0.87 114.38 123.91 1lr1 h ARG 18 Ca -0.06 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 58.75 1lr1 h ARG 18 Cb 1.31 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.83 1lr1 h ARG 18 CO 0.03 0.08 0.08 0.39 2.80 0.00 0.00 179.97 183.35 1lr1 n GLU 19 N -4.34 1.38 0.00 0.20 -0.58 -1.23 -4.85 120.64 111.22 1lr1 n GLU 19 Ca 0.26 -0.54 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 1lr1 n GLU 19 Cb 1.15 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 30.67 1lr1 n GLU 19 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1lr1 n SER 20 N 0.18 0.00 -4.99 1.62 3.41 0.30 -5.15 113.62 108.99 1lr1 n SER 20 Ca 0.09 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.50 1lr1 n SER 20 Cb 0.61 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.58 1lr1 n SER 20 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1lr1 s THR 21 N -1.78 2.46 -0.35 6.66 -4.23 -1.26 -4.99 115.64 112.15 1lr1 s THR 21 Ca 0.00 -1.10 0.25 0.00 -1.18 0.00 0.00 61.69 59.66 1lr1 s THR 21 Cb 0.00 -2.56 0.27 0.00 1.34 0.00 0.00 72.50 71.55 1lr1 s THR 21 CO 0.00 0.00 1.75 0.17 -0.54 0.00 0.00 174.62 176.00 1lr1 h LEU 22 N 0.52 0.00 -1.40 4.79 -0.00 -2.00 -3.12 115.31 114.10 1lr1 h LEU 22 Ca -0.36 0.00 0.37 0.00 -0.00 0.00 0.00 57.88 57.89 1lr1 h LEU 22 Cb 1.28 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.89 1lr1 h LEU 22 CO 0.46 0.00 1.22 -0.08 -0.00 0.00 0.00 178.44 180.05 1lr1 h GLU 23 N 0.00 0.00 -0.86 0.17 4.81 -1.98 1.11 114.58 117.84 1lr1 h GLU 23 Ca 0.00 0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.36 1lr1 h GLU 23 Cb 0.33 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.63 1lr1 h GLU 23 CO 0.00 0.00 0.47 0.00 -0.73 0.00 0.00 179.01 178.75 1lr1 h THR 24 N 0.00 0.80 -0.32 0.32 1.03 -1.95 0.05 112.91 112.84 1lr1 h THR 24 Ca 0.60 -0.24 -0.05 0.00 -0.01 0.00 0.00 66.41 66.71 1lr1 h THR 24 Cb 3.05 0.03 -0.01 0.00 -1.07 0.00 0.00 68.15 70.14 1lr1 h THR 24 CO -0.01 0.13 -0.01 0.17 -0.01 0.00 0.00 175.52 175.79 1lr1 h LEU 25 N 0.71 0.57 -2.03 0.00 8.10 0.10 0.24 115.31 123.00 1lr1 h LEU 25 Ca 0.45 -0.32 0.11 0.00 0.11 0.00 0.00 57.88 58.23 1lr1 h LEU 25 Cb 0.56 -0.15 -0.02 0.00 -0.44 0.00 0.00 40.66 40.61 1lr1 h LEU 25 CO -0.32 0.75 0.40 -0.08 -4.11 0.00 0.00 178.44 175.07 1lr1 h GLU 26 N 0.37 0.00 0.00 0.17 4.81 -1.08 3.73 114.58 122.58 1lr1 h GLU 26 Ca 0.09 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1lr1 h GLU 26 Cb 0.47 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1lr1 h GLU 26 CO 0.02 0.00 -0.26 0.93 -0.73 0.00 0.00 179.01 178.97 1lr1 h GLU 27 N 0.00 0.00 0.06 1.92 4.39 0.04 -3.31 114.58 117.67 1lr1 h GLU 27 Ca 0.19 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.60 1lr1 h GLU 27 Cb 0.97 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.60 1lr1 h GLU 27 CO -0.00 0.58 -1.54 0.00 -1.16 0.00 0.00 179.01 176.89 1lr1 h MET 28 N -1.00 0.12 -0.88 2.33 -0.00 0.55 -3.33 114.93 112.72 1lr1 h MET 28 Ca -0.06 -0.20 0.13 0.00 -0.00 0.00 0.00 59.70 59.58 1lr1 h MET 28 Cb 0.69 0.07 -0.09 0.00 -0.00 0.00 0.00 31.60 32.27 1lr1 h MET 28 CO -0.03 1.10 0.49 1.25 -0.00 0.00 0.00 176.91 179.72 1lr1 h LEU 29 N -0.56 0.66 -1.39 -0.10 5.85 0.69 0.91 115.31 121.37 1lr1 h LEU 29 Ca -0.37 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.39 1lr1 h LEU 29 Cb 1.61 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 1lr1 h LEU 29 CO -0.08 0.31 0.04 -0.08 -0.34 0.00 0.00 178.44 178.29 1lr1 h GLU 30 N 0.74 0.44 0.00 1.25 4.81 -1.46 -0.61 114.58 119.76 1lr1 h GLU 30 Ca 0.46 -0.07 -0.23 0.00 -0.13 0.00 0.00 59.36 59.38 1lr1 h GLU 30 Cb 0.57 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1lr1 h GLU 30 CO -0.32 0.44 -1.37 0.87 -0.73 0.00 0.00 179.01 177.91 1lr1 h LYS 31 N 0.44 0.00 0.00 1.92 1.79 -1.06 -2.78 116.57 116.87 1lr1 h LYS 31 Ca 0.10 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.53 1lr1 h LYS 31 Cb 0.23 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1lr1 h LYS 31 CO 0.00 0.61 -0.17 1.25 -1.08 0.00 0.00 179.45 180.06 1lr1 h LEU 32 N 0.00 0.00 0.14 2.94 5.85 0.12 -0.23 115.31 124.13 1lr1 h LEU 32 Ca -0.17 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.25 1lr1 h LEU 32 Cb 1.83 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.86 1lr1 h LEU 32 CO 0.09 0.17 -1.54 1.05 -0.34 0.00 0.00 178.44 177.87 1lr1 h GLU 33 N 0.00 0.29 -0.64 1.25 4.11 -1.15 -3.29 114.58 115.16 1lr1 h GLU 33 Ca -0.00 -0.49 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1lr1 h GLU 33 Cb 0.55 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1lr1 h GLU 33 CO 0.02 1.23 0.41 -0.39 0.07 0.00 0.00 179.01 180.36 1lr1 h VAL 34 N -0.17 1.17 -0.27 -1.06 -1.51 -1.21 1.41 116.25 114.60 1lr1 h VAL 34 Ca -0.32 -0.32 0.04 0.00 -1.23 0.00 0.00 66.70 64.86 1lr1 h VAL 34 Cb 1.87 0.24 -0.04 0.00 -2.13 0.00 0.00 31.29 31.23 1lr1 h VAL 34 CO 0.09 0.17 0.03 -0.37 -1.23 0.00 0.00 177.57 176.26 1lr1 h VAL 35 N 0.87 0.85 0.00 7.19 -1.51 -1.16 0.68 116.25 123.16 1lr1 h VAL 35 Ca 0.23 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 1lr1 h VAL 35 Cb -0.08 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 29.78 1lr1 h VAL 35 CO -0.05 0.02 0.00 -0.37 -1.23 0.00 0.00 177.57 175.94 1lr1 h VAL 36 N 0.13 0.00 -0.80 7.19 -1.51 -1.31 -2.10 116.25 117.85 1lr1 h VAL 36 Ca 0.13 -0.80 0.05 0.00 -1.23 0.00 0.00 66.70 64.84 1lr1 h VAL 36 Cb 0.15 1.80 -0.05 0.00 -2.13 0.00 0.00 31.29 31.05 1lr1 h VAL 36 CO -0.19 0.00 0.53 -1.13 -1.23 0.00 0.00 177.57 175.55 1lr1 h ASN 37 N 0.00 0.81 0.14 4.19 -1.24 0.42 2.46 115.58 122.36 1lr1 h ASN 37 Ca 0.00 -0.00 -0.25 0.00 0.71 0.00 0.00 56.30 56.75 1lr1 h ASN 37 Cb 0.82 -0.18 0.01 0.00 0.73 0.00 0.00 38.32 39.70 1lr1 h ASN 37 CO 0.00 0.54 -1.23 -0.33 -1.29 0.00 0.00 177.43 175.12 1lr1 h GLU 38 N 0.93 0.29 -0.08 6.67 4.39 -1.19 -3.24 114.58 122.35 1lr1 h GLU 38 Ca 0.33 -0.49 -0.02 0.00 0.34 0.00 0.00 59.36 59.52 1lr1 h GLU 38 Cb 0.13 0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1lr1 h GLU 38 CO -0.11 1.23 -0.03 0.00 -1.16 0.00 0.00 179.01 178.95 1lr1 h ARG 39 N -0.29 0.15 -0.73 2.33 -0.00 -0.87 0.18 114.38 115.15 1lr1 h ARG 39 Ca -0.25 -0.06 0.11 0.00 -0.50 0.00 0.00 59.98 59.28 1lr1 h ARG 39 Cb 1.76 -0.01 -0.08 0.00 0.00 0.00 0.00 29.97 31.64 1lr1 h ARG 39 CO 0.11 0.50 0.34 0.00 0.00 0.00 0.00 179.97 180.92 1lr1 h ARG 40 N -0.20 0.54 0.06 0.04 2.47 0.40 1.44 114.38 119.14 1lr1 h ARG 40 Ca 0.02 -0.03 -0.25 0.00 -1.26 0.00 0.00 59.98 58.46 1lr1 h ARG 40 Cb 0.45 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 1lr1 h ARG 40 CO 0.01 0.36 -1.08 0.93 0.56 0.00 0.00 179.97 180.75 1lr1 h GLU 41 N 0.56 0.33 0.16 0.04 5.08 -1.57 -3.16 114.58 116.01 1lr1 h GLU 41 Ca 0.38 -0.44 -0.29 0.00 -1.00 0.00 0.00 59.36 58.01 1lr1 h GLU 41 Cb 0.47 0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.87 1lr1 h GLU 41 CO -0.32 1.15 -1.32 1.49 -1.00 0.00 0.00 179.01 179.01 1lr1 h GLU 42 N 0.14 0.34 -0.08 2.33 4.57 0.02 -3.12 114.58 118.80 1lr1 h GLU 42 Ca -0.10 -0.59 0.01 0.00 -1.18 0.00 0.00 59.36 57.50 1lr1 h GLU 42 Cb 1.76 0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 30.56 1lr1 h GLU 42 CO 0.18 1.28 0.03 0.93 -1.18 0.00 0.00 179.01 180.25 1lr1 h GLU 43 N 0.09 0.07 -0.41 1.92 4.39 0.19 0.56 114.58 121.39 1lr1 h GLU 43 Ca -0.17 -0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.58 1lr1 h GLU 43 Cb 2.03 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.64 1lr1 h GLU 43 CO 0.22 0.05 0.28 0.66 -1.16 0.00 0.00 179.01 179.06 1lr1 h SER 44 N 0.08 0.30 -0.34 1.42 4.64 -1.66 0.79 113.55 118.77 1lr1 h SER 44 Ca 0.03 -0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.18 1lr1 h SER 44 Cb 0.01 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1lr1 h SER 44 CO -0.03 0.20 -0.43 0.00 -0.87 0.00 0.00 176.83 175.70 1lr1 h ALA 45 N 1.78 0.56 -0.66 5.18 0.00 -1.03 -2.75 119.26 122.33 1lr1 h ALA 45 Ca 0.18 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 1lr1 h ALA 45 Cb 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1lr1 h ALA 45 CO -0.04 0.68 0.11 0.00 0.00 0.00 0.00 179.25 180.00 1lr1 h ALA 46 N 0.77 0.94 -0.70 0.00 0.00 0.23 0.38 119.26 120.88 1lr1 h ALA 46 Ca 0.05 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1lr1 h ALA 46 Cb 1.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1lr1 h ALA 46 CO 0.10 0.66 0.28 0.00 0.00 0.00 0.00 179.25 180.30 1lr1 h ALA 47 N 1.08 1.19 0.19 0.00 0.00 -0.99 -0.71 119.26 120.03 1lr1 h ALA 47 Ca 0.20 -0.17 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 1lr1 h ALA 47 Cb 0.43 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.96 1lr1 h ALA 47 CO 0.01 0.59 -1.46 0.00 0.00 0.00 0.00 179.25 178.39 1lr1 h ALA 48 N 1.31 0.03 -0.59 0.00 0.00 -1.21 -3.34 119.26 115.46 1lr1 h ALA 48 Ca 0.24 -0.95 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 1lr1 h ALA 48 Cb 0.18 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1lr1 h ALA 48 CO -0.02 0.90 0.19 1.49 0.00 0.00 0.00 179.25 181.80 1lr1 h GLU 49 N 0.11 0.91 -5.49 0.00 4.57 -0.08 -3.41 114.58 111.18 1lr1 h GLU 49 Ca -0.23 -0.19 -0.50 0.00 -1.18 0.00 0.00 59.36 57.26 1lr1 h GLU 49 Cb 2.08 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 30.52 1lr1 h GLU 49 CO 0.22 0.81 1.65 1.55 -1.18 0.00 0.00 179.01 182.06 1lr1 n VAL 50 N -4.42 -0.02 0.00 0.32 3.14 -0.29 -4.91 118.33 112.15 1lr1 n VAL 50 Ca 0.03 -0.53 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 1lr1 n VAL 50 Cb 0.20 -2.07 0.00 0.00 -1.06 0.00 0.00 33.84 30.91 1lr1 n VAL 50 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 1lr1 n GLU 51 N 8.79 2.40 -1.45 1.45 0.28 -1.26 -4.92 120.64 125.93 1lr1 n GLU 51 Ca 0.45 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 1lr1 n GLU 51 Cb 0.38 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.25 1lr1 n GLU 51 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1lr1 n GLU 52 N 0.00 -3.90 0.00 3.44 2.13 -1.25 -4.51 120.64 116.55 1lr1 n GLU 52 Ca 0.00 2.84 0.00 0.00 0.66 0.00 0.00 57.16 60.66 1lr1 n GLU 52 Cb 0.00 -3.06 0.00 0.00 0.27 0.00 0.00 31.44 28.65 1lr1 n GLU 52 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1lr1 n ARG 53 N 0.57 0.00 0.06 5.31 3.00 -1.26 -4.44 116.66 119.90 1lr1 n ARG 53 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.72 1lr1 n ARG 53 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.37 1lr1 n ARG 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1lr1 h THR 54 N 0.00 1.05 0.00 5.15 1.03 -1.92 -3.49 112.91 114.74 1lr1 h THR 54 Ca 0.00 -0.83 0.00 0.00 -0.01 0.00 0.00 66.41 65.57 1lr1 h THR 54 Cb 0.00 1.57 0.00 0.00 -1.07 0.00 0.00 68.15 68.65 1lr1 h THR 54 CO 0.00 0.20 0.00 0.54 -0.01 0.00 0.00 175.52 176.25 1lr1 n ARG 55 N -4.98 0.00 0.00 0.00 1.74 -1.26 -5.10 116.66 107.06 1lr1 n ARG 55 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1lr1 n ARG 55 Cb 0.23 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.67 1lr1 n ARG 55 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1lr1 n LYS 56 N 0.00 0.00 0.00 5.56 3.00 -1.26 -3.81 118.16 121.65 1lr1 n LYS 56 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.33 1lr1 n LYS 56 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 35.03 35.17 1lr1 n LYS 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68